methyl 4-[1-(phenylmethyl)pyrrol-3-yl]benzoate

Systemtic Name: methyl 4-[1-(phenylmethyl)pyrrol-3-yl]benzoate Openeye Name: methyl 4-(1-benzylpyrrol-3-yl)benzoate CAS Name: 4-[1-(phenylmethyl)-3-pyrrolyl]benzoic acid methyl ester IUPAC Name: methyl 4-(1-benzylpyrrol-3-yl)benzoate Traditional Name: 4-(1-benzylpyrrol-3-yl)benzoic acid methyl ester Formula: C19H17NO2 MolecularWeight: 291.34378

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C2=CN(C=C2)CC3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)C2=CN(C=C2)CC3=CC=CC=C3

InChI

InChI=1S/C19H17NO2/c1-22-19(21)17-9-7-16(8-10-17)18-11-12-20(14-18)13-15-5-3-2-4-6-15/h2-12,14H,13H2,1H3